(3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol

C17H17FO3 — CID 114521405

IUPAC(3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol
SMILESCOc1cccc(F)c1C(O)c1cccc(OC2CC2)c1
InChIInChI=1S/C17H17FO3/c1-20-15-7-3-6-14(18)16(15)17(19)11-4-2-5-13(10-11)21-12-8-9-12/h2-7,10,12,17,19H,8-9H2,1H3
InChIKeyFBFOVGZGHHYHBL-UHFFFAOYSA-N
MW288.32 g/mol
LogP3.46
Rot. Bonds5

About (3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol

(3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol (PubChem CID 114521405) has the molecular formula C17H17FO3 and a molecular weight of 288.32 g/mol. Its IUPAC name is (3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol.

Molecular Properties

Compound Name(3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol
PubChem CID114521405
Molecular FormulaC17H17FO3
Molecular Weight288.32 g/mol
Exact Mass288.12
IUPAC Name(3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol
SMILESCOc1cccc(F)c1C(O)c1cccc(OC2CC2)c1
InChIInChI=1S/C17H17FO3/c1-20-15-7-3-6-14(18)16(15)17(19)11-4-2-5-13(10-11)21-12-8-9-12/h2-7,10,12,17,19H,8-9H2,1H3
InChIKeyFBFOVGZGHHYHBL-UHFFFAOYSA-N
XLogP3.46
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.32
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-amino-3-methoxyphenyl)-(3-cyclopropyloxyphenyl)methanol
CID 107469550
(2,6-difluorophenyl)-(3-methoxyphenyl)methanol
CID 63893352
(3-cyclopropyloxyphenyl)-(3,5-difluorophenyl)methanol
CID 114521308
(3-cyclopropyloxyphenyl)-(4-methylsulfanylphenyl)methanol
CID 115838445
(2-fluoro-6-methoxyphenyl)-(4-fluoro-3-methylphenyl)methanol
CID 79747390
(4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol
CID 115838349
(3-bromo-4-fluorophenyl)-(2-fluoro-6-methoxyphenyl)methanol
CID 79746374
2,3-dihydro-1H-inden-5-yl-(2-fluoro-6-methoxyphenyl)methanol
CID 65434633
(2-bromo-4-fluorophenyl)-(3-cyclopropyloxyphenyl)methanol
CID 115838473
(3-cyclopropyloxyphenyl)-(5-fluoro-2-pyridinyl)methanol
CID 114521398
(2-bromo-5-methoxyphenyl)-(3-cyclopropyloxyphenyl)methanol
CID 105131480
(3-cyclopropyloxyphenyl)-(3-iodophenyl)methanol
CID 115838435

Frequently Asked Questions

What is the IUPAC name of (3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol?
The IUPAC name of (3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol (CID 114521405) is (3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol.
What is the SMILES notation for (3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol?
The canonical SMILES for (3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol is COc1cccc(F)c1C(O)c1cccc(OC2CC2)c1.
What is the InChIKey of (3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol?
The InChIKey is FBFOVGZGHHYHBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FO3/c1-20-15-7-3-6-14(18)16(15)17(19)11-4-2-5-13(10-11)21-12-8-9-12/h2-7,10,12,17,19H,8-9H2,1H3.
What are the key properties of (3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol?
(3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol has a molecular weight of 288.32 g/mol, XLogP of 3.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropyloxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol is sourced from PubChem (CID 114521405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).